SCHEMBL2393953

SCHEMBL2393953

COc1cc(F)ccc1-c1ccc2c(c1C(O)C(=O)c1cccs1)C(C)=CC(C)(C)N2

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 13/20 0.43
PGR P06401 10/20 0.42
AR P10275 2/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
NR3C2 P08235 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL462616 0.86 PGR (0.49) NR3C1PGRARESR1ESR2
SCHEMBL5034310 0.83 NR3C1 (0.41) NR3C1PGRARESR1ESR2
SCHEMBL4423368 0.83 MAPT (0.39) NR3C1PGRARNR3C2
SCHEMBL2395535 0.82 PGR (0.43) NR3C1PGRARESR1ESR2
SCHEMBL450303 0.81 NR3C1 (0.43) NR3C1PGRARESR1ESR2
SCHEMBL1779600 0.79 MAPT (0.40) NR3C1PGRARESR1ESR2
SCHEMBL2391814 0.78 NR3C1 (0.49) NR3C1PGRARESR1ESR2
SCHEMBL5132462 0.77 PGR (0.47) NR3C1PGRARESR1ESR2
SCHEMBL5040811 0.77 NR3C1 (0.46) NR3C1PGRARESR1ESR2
SCHEMBL1315415 0.77 NR3C1 (0.42) NR3C1PGRARNR3C2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420635-B2 Method for preventing or treating a glucocorticoid receptor-related disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-04-16 US claimed
US-8017775-B2 1-2-dihydroquinoline derivative having glucocorticoid receptor binding activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-09-13 US claimed